BP Fluor 594 alkyne

CAT: 0931-T206460-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T206460-01Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1962073-89-7

Bioactivity

BP Fluor 594 alkyne is a bright red fluorescent alkyne-activated probe frequently utilized for imaging biomolecules containing azides. It reacts with azides via a copper-catalyzed click reaction (CuAAC) to form a stable triazole linkage.

Smiles

O=C([O-])C=1C=C(C=CC1C=2C3=CC4=C(C=C3[O+]=C5C=C6C(=CC52)C(=CC(N6C)(C)C)CS(=O)(=O)O)N(C)C(C=C4CS(=O)(=O)O)(C)C)C(=O)NCC#C

Molecular Formula

C38H37N3O10S2

Molecular Weight

759.844

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

2-(1,2,2,10,10,11-Hexamethyl-4,8-bis(sulfomethyl)-1,2,10,11-tetrahydropyrano[3,2-G:5,6-G']diquinolin-13-ium-6-YL)-5-(prop-2-YN-1-ylcarbamoyl)benzoate

CAS Number	1962073-89-7
PubChem CID	172639532
IUPAC Name	2-[6,7,7,19,19,20-hexamethyl-9,17-bis(sulfomethyl)-2-oxa-20-aza-6-azoniapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(14),3,5,8,10,12,15,17,21-nonaen-13-yl]-5-(prop-2-ynylcarbamoyl)benzoate
Molecular Formula	C38H37N3O10S2
Molecular Weight	759.8
XLogP	1.3
Topological Polar Surface Area	210
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	7
Heavy Atom Count	53
Formal Charge	0
Complexity	1970

SMILES

CC1(C=C(C2=CC3=C(C=C2N1C)OC4=CC5=[N+](C(C=C(C5=CC4=C3C6=C(C=C(C=C6)C(=O)NCC#C)C(=O)[O-])CS(=O)(=O)O)(C)C)C)CS(=O)(=O)O)C

InChI

InChI=1S/C38H37N3O10S2/c1-8-11-39-35(42)21-9-10-24(27(12-21)36(43)44)34-28-13-25-22(19-52(45,46)47)17-37(2,3)40(6)30(25)15-32(28)51-33-16-31-26(14-29(33)34)23(20-53(48,49)50)18-38(4,5)41(31)7/h1,9-10,12-18H,11,19-20H2,2-7H3,(H3-,39,42,43,44,45,46,47,48,49,50)

InChIKey

OQRQNTQBWKMCGN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1962073-89-7

CID: 172639532

Formula: C38H37N3O10S2

MW: 759.8

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	759.8
XLogP3	1.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	7
Exact Mass	759.19203673
Monoisotopic Mass	759.19203673
Topological Polar Surface Area	210 Å²
Heavy Atom Count	53
Formal Charge	0
Complexity	1970
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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sc-460824	Tide Fluor™ 5 alkyne [TF5 alkyne]
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2303-AAT	Tide Fluor™ 6WS alkyne [TF6WS alkyne]
2276-AAT	Tide Fluor™ 5WS alkyne [TF5WS alkyne]
sc-460833	Tide Fluor™ 8 alkyne [TF8 alkyne]
sc-460828	Tide Fluor™ 6 alkyne [TF6 alkyne]

BP Fluor 594 alkyne

Chemical Information

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